General Information of the Compound
| Compound ID |
CP0408768
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| Compound Name |
5-chloro-2-(3,5-dimethylphenyl)-4-(4-ethoxyphenoxy)pyridazin-3-one
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| Structure |
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| Formula |
C20H19ClN2O3
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| Molecular Weight |
370.836
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| Canonical SMILES |
CCOc1ccc(Oc2c(Cl)cnn(-c3cc(C)cc(C)c3)c2=O)cc1
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| InChI |
InChI=1S/C20H19ClN2O3/c1-4-25-16-5-7-17(8-6-16)26-19-18(21)12-22-23(20(19)24)15-10-13(2)9-14(3)11-15/h5-12H,4H2,1-3H3
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| InChIKey |
WCSFWRKFMPYRBM-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound